SCHEMBL28064133

SCHEMBL28064133

NC(=O)N(N)c1ccc(-c2ccc(N(N)C(N)=O)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ MMP2 P08253 1/20 0.34
▸ KIF11 P52732 4/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ CA14 Q9ULX7 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.32
▸ LRRK2 Q5S007 1/20 0.32
▸ MKNK1 Q9BUB5 2/20 0.31
▸ MKNK2 Q9HBH9 2/20 0.31
▸ DHODH Q02127 1/20 0.31
▸ IKBKB O14920 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CDC7 O00311 1/20 0.31
▸ CDK9 P50750 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27552505 0.92 NPSR1 (0.36) CA12CA1CA2ALOX5NPSR1
SCHEMBL9233431 0.83 ALDH1A1 (0.42) CA14CYP2C9
SCHEMBL27944475 0.81 RAB9A (0.45) —
SCHEMBL11030370 0.81 ALOX5 (0.46) KIF11ALOX5NPSR1
SCHEMBL17161281 0.81 ALOX5 (0.44) HDAC1HDAC6CA1CA2ALOX5
SCHEMBL27947114 0.81 HPGD (0.52) CYP2C9
SCHEMBL6477818 0.81 TPMT (0.39) CA12CA1CA2CA9
SCHEMBL712279 0.80 NPSR1 (0.54) ALOX5NPSR1
SCHEMBL28154370 0.79 HSD17B3 (0.42) HDAC1HDAC6
SCHEMBL28153104 0.79 NPC1 (0.44) CA12CA2CA9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107033773-A A kind of low viscosity enamel-covered wire polyimide varnish and its production and use 南京中鸿润宁新材料科技有限公司 2017-08-11 — — CN claimed
CN-106519685-A Polyimide material and preparing method and application thereof 南京中鸿润宁新材料科技有限公司 2017-03-22 — — CN claimed
CN-107033773-A A kind of low viscosity enamel-covered wire polyimide varnish and its production and use 南京中鸿润宁新材料科技有限公司 2017-08-11 — — CN disclosed
CN-104086773-B In a kind of skeleton, contain chirality polysilsesquioxane of arlydene and its preparation method and application SUZHOU UNIVERSITY (CN) 2016-05-11 — — CN disclosed
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